UCSF

ZINC18163642

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2008 30 No

Popular Name: 5-[(4-ethoxyanilino)methylene]-4-methyl-2,6-dioxo-1-(2-phenylethyl)-1,2,5,6-tetrahydro-3-pyridinecarbonitrile 5-[(4-ethoxyanilino)methylene]-4…

Find On: PubMed — Wikipedia — Google

Other Names:

MFCD03866983

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.81 11.52 -21.42 1 6 0 84 401.466 7 ↓
Ref Reference (pH 7) 3.81 11.68 -20.23 1 6 0 84 401.466 7 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )